7-methyl-4-(4-methylphenyl)-2-(thiophen-2-yl)-1H-1,3,5-benzotriazepine
Chemical Structure Depiction of
7-methyl-4-(4-methylphenyl)-2-(thiophen-2-yl)-1H-1,3,5-benzotriazepine
7-methyl-4-(4-methylphenyl)-2-(thiophen-2-yl)-1H-1,3,5-benzotriazepine
Compound characteristics
| Compound ID: | D165-0153 |
| Compound Name: | 7-methyl-4-(4-methylphenyl)-2-(thiophen-2-yl)-1H-1,3,5-benzotriazepine |
| Molecular Weight: | 331.44 |
| Molecular Formula: | C20 H17 N3 S |
| Smiles: | Cc1ccc(cc1)C1N=C(c2cccs2)Nc2ccc(C)cc2N=1 |
| Stereo: | ACHIRAL |
| logP: | 5.2103 |
| logD: | 5.2069 |
| logSw: | -5.103 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.493 |
| InChI Key: | RUWSNQKOLAZNJF-UHFFFAOYSA-N |